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82558-67-6 | Benzamide, N-[3-(1,1-dimethyltetradecyl)-5-isoxazolyl]-2,6-dimethoxy-
CAS No: 82558-67-6 Catalog No: AG00572U MDL No:
Product Description
Catalog Number:
AG00572U
Chemical Name:
Benzamide, N-[3-(1,1-dimethyltetradecyl)-5-isoxazolyl]-2,6-dimethoxy-
CAS Number:
82558-67-6
Molecular Formula:
C28H44N2O4
Molecular Weight:
472.6600
IUPAC Name:
2,6-dimethoxy-N-[3-(2-methylpentadecan-2-yl)-1,2-oxazol-5-yl]benzamide
InChI:
InChI=1S/C28H44N2O4/c1-6-7-8-9-10-11-12-13-14-15-16-20-28(2,3)24-21-25(34-30-24)29-27(31)26-22(32-4)18-17-19-23(26)33-5/h17-19,21H,6-16,20H2,1-5H3,(H,29,31)
InChI Key:
GHANTNAQVYNLMO-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC(c1noc(c1)NC(=O)c1c(OC)cccc1OC)(C)C
Properties
Complexity:
545
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
472.33g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
472.67g/mol
Monoisotopic Mass:
472.33g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.5
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